{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.868442 1.548768 -0.0387904 ] [ -1.0121013 0.5734905 -0.3225605 ] [ 1.5426304 1.6804627 -1.2096805 ] [ -1.0586054 0.366074 -2.2432337 ] [ 0.5925482 -0.6317794 1.4343122 ] [ -1.4262272 -1.4170112 1.4908455 ] [ 2.2180352 -1.0507428 1.0098894 ] [ -1.7247219 -1.0692619 -0.1207821 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.391397468920794e-09 2.481399880643174e-09 -6.214907199148033e-11 ] [ -1.621565040741287e-09 9.188330713509024e-10 -5.167988918935585e-10 ] [ 2.471566361415352e-09 2.692398050066444e-09 -1.938121815737654e-09 ] [ -1.696072822532633e-09 5.865152042827393e-10 -3.594056589130681e-09 ] [ 9.493668727371226e-10 -1.012222184183052e-09 2.298021473768213e-09 ] [ -2.285067875789046e-09 -2.270302216051753e-09 2.388597805324887e-09 ] [ 3.553684141551452e-09 -1.68347554863393e-09 1.61802118627374e-09 ] [ -2.763309105561755e-09 -1.713146417692188e-09 -1.935142568311277e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.613499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.866129210348418e-18 } }